1-[3-chloro-6-[1,4-dimethyl-5-(methylaminomethyl)pyrazol-3-yl]pyrazolo[1,5-a]pyridin-4-yl]oxy-2-(5-fluoro-2-pyridinyl)butan-2-ol

C23H26ClFN6O2 — CID 178131239

IUPAC1-[3-chloro-6-[1,4-dimethyl-5-(methylaminomethyl)pyrazol-3-yl]pyrazolo[1,5-a]pyridin-4-yl]oxy-2-(5-fluoro-2-pyridinyl)butan-2-ol
SMILESCCC(O)(COc1cc(-c2nn(C)c(CNC)c2C)cn2ncc(Cl)c12)c1ccc(F)cn1
InChIInChI=1S/C23H26ClFN6O2/c1-5-23(32,20-7-6-16(25)9-27-20)13-33-19-8-15(12-31-22(19)17(24)10-28-31)21-14(2)18(11-26-3)30(4)29-21/h6-10,12,26,32H,5,11,13H2,1-4H3
InChIKeyLTLWTSKXQXNUEI-UHFFFAOYSA-N
MW472.95 g/mol
LogP3.63
Rot. Bonds8

About 1-[3-chloro-6-[1,4-dimethyl-5-(methylaminomethyl)pyrazol-3-yl]pyrazolo[1,5-a]pyridin-4-yl]oxy-2-(5-fluoro-2-pyridinyl)butan-2-ol

1-[3-chloro-6-[1,4-dimethyl-5-(methylaminomethyl)pyrazol-3-yl]pyrazolo[1,5-a]pyridin-4-yl]oxy-2-(5-fluoro-2-pyridinyl)butan-2-ol (PubChem CID 178131239) has the molecular formula C23H26ClFN6O2 and a molecular weight of 472.95 g/mol. Its IUPAC name is 1-[3-chloro-6-[1,4-dimethyl-5-(methylaminomethyl)pyrazol-3-yl]pyrazolo[1,5-a]pyridin-4-yl]oxy-2-(5-fluoro-2-pyridinyl)butan-2-ol.

Molecular Properties

Compound Name1-[3-chloro-6-[1,4-dimethyl-5-(methylaminomethyl)pyrazol-3-yl]pyrazolo[1,5-a]pyridin-4-yl]oxy-2-(5-fluoro-2-pyridinyl)butan-2-ol
PubChem CID178131239
Molecular FormulaC23H26ClFN6O2
Molecular Weight472.95 g/mol
Exact Mass472.18
IUPAC Name1-[3-chloro-6-[1,4-dimethyl-5-(methylaminomethyl)pyrazol-3-yl]pyrazolo[1,5-a]pyridin-4-yl]oxy-2-(5-fluoro-2-pyridinyl)butan-2-ol
SMILESCCC(O)(COc1cc(-c2nn(C)c(CNC)c2C)cn2ncc(Cl)c12)c1ccc(F)cn1
InChIInChI=1S/C23H26ClFN6O2/c1-5-23(32,20-7-6-16(25)9-27-20)13-33-19-8-15(12-31-22(19)17(24)10-28-31)21-14(2)18(11-26-3)30(4)29-21/h6-10,12,26,32H,5,11,13H2,1-4H3
InChIKeyLTLWTSKXQXNUEI-UHFFFAOYSA-N
XLogP3.63
TPSA89.50 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds8
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500472.95
LogP ≤ 53.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

Analyze 1-[3-chloro-6-[1,4-dimethyl-5-(methylaminomethyl)pyrazol-3-yl]pyrazolo[1,5-a]pyridin-4-yl]oxy-2-(5-fluoro-2-pyridinyl)butan-2-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[3-chloro-6-[5-methyl-1-[1-(oxetan-3-yl)piperidin-4-yl]triazol-4-yl]pyrazolo[1,5-a]pyridin-4-yl]oxy-2-(5-fluoro-2-pyridinyl)butan-2-ol
CID 169267286
1-[3-chloro-6-[1-[(3R,4R)-3-fluoropiperidin-4-yl]-5-methyltriazol-4-yl]pyrazolo[1,5-a]pyridin-4-yl]oxy-2-(5-fluoro-2-pyridinyl)propan-2-ol
CID 176863944
tert-butyl 4-[4-[3-chloro-4-[2-(5-fluoro-2-pyridinyl)-2-hydroxypropoxy]pyrazolo[1,5-a]pyridin-6-yl]-5-methyltriazol-1-yl]piperidine-1-carboxylate
CID 164920333
(2R)-1-[3-chloro-6-[1-[(3S,4R)-3-fluoro-1-(oxetan-3-yl)piperidin-4-yl]-5-methyltriazol-4-yl]pyrazolo[1,5-a]pyridin-4-yl]oxy-2-(5-fluoro-2-pyridinyl)propan-2-ol
CID 169267619
(2S)-1-[3-chloro-6-[1-[(3S)-3-fluoro-1-(oxetan-3-yl)piperidin-4-yl]-5-methyltriazol-4-yl]pyrazolo[1,5-a]pyridin-4-yl]oxy-2-(5-fluoro-2-pyridinyl)propan-2-ol
CID 169267415
1-[2-[3-chloro-4-[2-(5-fluoro-2-pyridinyl)ethoxy]pyrazolo[1,5-a]pyridin-6-yl]-3-methyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]ethenylcyanamide
CID 178131291
2-(5-fluoro-2-pyridinyl)-1-(methylamino)butan-2-ol
CID 112586602
tert-butyl 4-[4-[3-chloro-4-[2-(5-fluoro-2-pyridinyl)-2-oxoethoxy]pyrazolo[1,5-a]pyridin-6-yl]-5-methyltriazol-1-yl]piperidine-1-carboxylate
CID 164920913
2-(6-bromo-3-chloropyrazolo[1,5-a]pyridin-4-yl)oxy-1-(5-fluoro-2-pyridinyl)ethanone
CID 169267488
1-[4-[4-[3-fluoro-4-[2-(5-fluoro-2-pyridinyl)-2-hydroxypropoxy]pyrazolo[1,5-a]pyridin-6-yl]-5-methyltriazol-1-yl]piperidin-1-yl]prop-2-en-1-one
CID 171074764
4-[4-[3-chloro-4-[1-(5-fluoro-2-pyridinyl)-2-hydroxyethoxy]pyrazolo[1,5-a]pyridin-6-yl]-5-methyltriazol-1-yl]piperidine-1-carbonitrile
CID 164920552
(3R,4R)-4-[4-[3-chloro-4-[1-(5-fluoro-2-pyridinyl)-2-hydroxyethoxy]pyrazolo[1,5-a]pyridin-6-yl]-5-methyltriazol-1-yl]piperidin-3-ol;hydrochloride
CID 175872881

Frequently Asked Questions

What is the IUPAC name of 1-[3-chloro-6-[1,4-dimethyl-5-(methylaminomethyl)pyrazol-3-yl]pyrazolo[1,5-a]pyridin-4-yl]oxy-2-(5-fluoro-2-pyridinyl)butan-2-ol?
The IUPAC name of 1-[3-chloro-6-[1,4-dimethyl-5-(methylaminomethyl)pyrazol-3-yl]pyrazolo[1,5-a]pyridin-4-yl]oxy-2-(5-fluoro-2-pyridinyl)butan-2-ol (CID 178131239) is 1-[3-chloro-6-[1,4-dimethyl-5-(methylaminomethyl)pyrazol-3-yl]pyrazolo[1,5-a]pyridin-4-yl]oxy-2-(5-fluoro-2-pyridinyl)butan-2-ol.
What is the SMILES notation for 1-[3-chloro-6-[1,4-dimethyl-5-(methylaminomethyl)pyrazol-3-yl]pyrazolo[1,5-a]pyridin-4-yl]oxy-2-(5-fluoro-2-pyridinyl)butan-2-ol?
The canonical SMILES for 1-[3-chloro-6-[1,4-dimethyl-5-(methylaminomethyl)pyrazol-3-yl]pyrazolo[1,5-a]pyridin-4-yl]oxy-2-(5-fluoro-2-pyridinyl)butan-2-ol is CCC(O)(COc1cc(-c2nn(C)c(CNC)c2C)cn2ncc(Cl)c12)c1ccc(F)cn1.
What is the InChIKey of 1-[3-chloro-6-[1,4-dimethyl-5-(methylaminomethyl)pyrazol-3-yl]pyrazolo[1,5-a]pyridin-4-yl]oxy-2-(5-fluoro-2-pyridinyl)butan-2-ol?
The InChIKey is LTLWTSKXQXNUEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H26ClFN6O2/c1-5-23(32,20-7-6-16(25)9-27-20)13-33-19-8-15(12-31-22(19)17(24)10-28-31)21-14(2)18(11-26-3)30(4)29-21/h6-10,12,26,32H,5,11,13H2,1-4H3.
What are the key properties of 1-[3-chloro-6-[1,4-dimethyl-5-(methylaminomethyl)pyrazol-3-yl]pyrazolo[1,5-a]pyridin-4-yl]oxy-2-(5-fluoro-2-pyridinyl)butan-2-ol?
1-[3-chloro-6-[1,4-dimethyl-5-(methylaminomethyl)pyrazol-3-yl]pyrazolo[1,5-a]pyridin-4-yl]oxy-2-(5-fluoro-2-pyridinyl)butan-2-ol has a molecular weight of 472.95 g/mol, XLogP of 3.63, 8 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-chloro-6-[1,4-dimethyl-5-(methylaminomethyl)pyrazol-3-yl]pyrazolo[1,5-a]pyridin-4-yl]oxy-2-(5-fluoro-2-pyridinyl)butan-2-ol is sourced from PubChem (CID 178131239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).